About: methyl (4aR,5S,6R,8aR)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate

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About: methyl (4aR,5S,6R,8aR)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate Goto Sponge NotDistinct Permalink

An Entity of Type : wikibase:Item, within Data Space : wikidata.demo.openlinksw.com associated with source document(s)

chemical compound

Attributes	Values
rdf:type	Item
description	composto chimico (it) химическое соединение (ru) chemical compound (en) composé chimique (fr) תרכובת (he) kemisk forbindelse (da) compositum chemicum (la) chemische Verbindung (de) քիմիական միացություն (hy) chemická sloučenina (cs) chemická zlúčenina (sk) chemische verbinding (nl) kemia kombinaĵo (eo) związek chemiczny (pl) chemical compound (en-ca) chemical compound (en-gb) chemiese verbinding (af) chemische Verbindung (de-ch) component quimic (oc) compost químic (ca) composto químico (gl) composto químico (pt) composto químico (pt-br) compuesto quimico (an) compuestu químicu (ast) compus chimic (ro) kemiallinen yhdiste (fi) kjemisk forbindelse (nb) kjemisk sambinding (nn) komponim kimik (sq) konposatu kimiko (eu) senyawa kimia (id) ķīmisks savienojums (lv) хімічна сполука (uk) مركب كيميائي (ar) রাসায়নিক যৌগ (bn) compuesto químico (es) payvastagii khimiyaviy (tg-latn) пайвастагии химиявӣ (tg-cyrl) chemesch Verbindung (lb)
rdfs:label	methyl (4aR,5S,6R,8aR)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate (en)
skos:prefLabel	methyl (4aR,5S,6R,8aR)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate (en)
name	methyl (4aR,5S,6R,8aR)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate (en)
isomeric SMILES	wds:Q104913620-904B4ACB-C70C-469C-AF3B-D3136AF824F2
isomeric SMILES	C=C[C@@](C)(O)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C(=O)OC)=CCC[C@H]12
instance of	wds:Q104913620-152C170B-95E9-4437-961E-309E4A14A6A4
instance of	type of chemical entity
subclass of	wds:Q104913620-9FCFD73F-A168-43E0-A807-1B082D4EABF4
subclass of	Methyl 5-(3-hydroxy-3-methylpent-4-enyl)-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylate
found in taxon	wds:Q104913620-DACF00A1-1DFB-49C2-B607-CB1B8AA3AD90
found in taxon	Scapania bolanderi
canonical SMILES	wds:Q104913620-44748478-D916-4F2B-91D5-5DBDC415606D
InChI	wds:Q104913620-DAF1CD02-02E0-4056-AF8A-1204C72F51D9
InChIKey	wds:Q104913620-AE3CD857-34A7-4DFC-AB13-532B50F1A65C
chemical formula	wds:Q104913620-473C3D8A-B816-4359-BB1C-AE22AF15C72E
PubChem CID	wds:Q104913620-B0B0E9A4-2163-44D2-AF65-02734FD4BD0A
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID162885758
canonical SMILES	O=C(OC)C1=CCCC2C1(C)CCC(C)C2(C)CCC(O)(C=C)C
InChI	InChI=1S/C21H34O3/c1-7-19(3,23)13-14-20(4)15(2)11-12-21(5)16(18(22)24-6)9-8-10-17(20)21/h7,9,15,17,23H,1,8,10-14H2,2-6H3/t15-,17-,19-,20+,21+/m1/s1
InChIKey	AKFSYMQHQPROTH-LBEXIJAVSA-N
chemical formula	C₂₁H₃₄O₃
PubChem CID	162885758
mass	wds:Q104913620-42AFFC40-7639-44C1-855D-1DD4E5ACE347
mass	334.250794948 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q104913620
is main subject of	Isolation of Seven Verrucosane Diterpenoids from the Liverwort Scapania bolanderi
is main subject of	wds:Q104913618-B6080638-7B27-4E2E-97E1-F45B45389534

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